CID 88752789

C2H6AlClOSi — CID 88752789

IUPAC—
SMILESC[Si](C)(Cl)O[Al]
InChIInChI=1S/C2H6ClOSi.Al/c1-5(2,3)4;/h1-2H3;/q-1;+1
InChIKeyISOXPVAYFKIQHL-UHFFFAOYSA-N
MW136.59 g/mol
LogP1.03
Rot. Bonds1

About CID 88752789

CID 88752789 (PubChem CID 88752789) has the molecular formula C2H6AlClOSi and a molecular weight of 136.59 g/mol.

Molecular Properties

Compound NameCID 88752789
PubChem CID88752789
Molecular FormulaC2H6AlClOSi
Molecular Weight136.59 g/mol
Exact Mass135.97
IUPAC Name—
SMILESC[Si](C)(Cl)O[Al]
InChIInChI=1S/C2H6ClOSi.Al/c1-5(2,3)4;/h1-2H3;/q-1;+1
InChIKeyISOXPVAYFKIQHL-UHFFFAOYSA-N
XLogP1.03
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.59
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 88752789?
The IUPAC name of CID 88752789 (CID 88752789) is not available.
What is the SMILES notation for CID 88752789?
The canonical SMILES for CID 88752789 is C[Si](C)(Cl)O[Al].
What is the InChIKey of CID 88752789?
The InChIKey is ISOXPVAYFKIQHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6ClOSi.Al/c1-5(2,3)4;/h1-2H3;/q-1;+1.
What are the key properties of CID 88752789?
CID 88752789 has a molecular weight of 136.59 g/mol, XLogP of 1.03, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 88752789 is sourced from PubChem (CID 88752789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).